설파세타마이드

Sulfacetamide

HCID 5320CAS 144-80-9

기본 정보

표준 SMILES
CC(=O)NS(=O)(=O)c1ccc(N)cc1
InChIKey
SKIVFJLNDNKQPD-UHFFFAOYSA-N
분자식
C8H10N2O3S
평균 분자량
214.24 g/mol
단동위원소 질량
214.04121318

개요

Sulfacetamide is a white powder. (NTP, 1992)

이름 및 식별자

우선 이름
Sulfacetamide
IUPAC
N-(4-aminophenyl)sulfonylacetamide
현지명
설파세타마이드
영어명
Sulfacetamide
분자식
C8H10N2O3S
분자량
214.24

이름 및 동의어

sulfacetamide144-80-9SulphacetamideAcetosulfamineN-((4-Aminophenyl)sulfonyl)acetamideN-AcetylsulfanilamideUrosulfonN-SulfanilylacetamideAcetosulfaminAcetocidSulfacetN-(4-aminophenyl)sulfonylacetamide
이름 더 보기
설파세타마이드A-500RegionOclucidSebizonAlbucidSulf-10sultrin
N-SulphanilylacetamideFormosulfacetamideSulfacetimideAlbamineSulphasilUrosulfoneAlestenSulamyd

데이터베이스 식별자

CAS
144-80-9
PubChem CID
5320
DTXSID
DTXSID8026060
ChEMBL
CHEMBL455
ChEBI
CHEBI:63845
UNII
4965G3J0F5
EC Number
205-640-6
Nikkaji
J8.635E

물성

구조 계산 물성

XLogP
-1
극성 표면적
97.6 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
4
회전 가능 결합 수
2
무거운 원자 수
14

실험 및 물리화학적 성질

Drugs · 2건

Pharmaceuticals -> Antibiotics

Pharmaceuticals -> Listed in ZINC15

SpringerMaterials PropertiesNuclear quadrupole resonance spectroscopy
LogP · 2건

-0.6

-0.1

Solubility · 3건

less than 0.1 mg/mL at 61 °F (NTP, 1992)

4.21e+00 g/L

>32.1 [ug/mL] (The mean of the results at pH 7.4)

Human Drugs · 2건

FDA approved drugs -> Active ingredient

FDA approved drugs -> Active ingredient

Animal DrugsPharmaceuticals -> Animal Drugs -> Approved in Taiwan

물리화학적 성질

녹는점
182 · 182-184 °C
밀도
1.3844 · 1.3844 (rough estimate)
굴절률
1.569 · 1.5690 (estimate)
저장 조건
Keep in dark place,Inert atmosphere,Room temperature
용해도
50 mg/mL · 에탄올: 용해성50mg/mL
산도 계수 (pKa)
1.76 · pKa 1.76±0.04(H2O t = 25 I = 0.15 (KCl) Ar atmosphere)(Approximate);5.22±0.01(H2O t = 25 I = 0.15 (KCl) Ar atmosphere)(Approximate)

화학적 성질

white crystalline powder

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 10% (4 of 40) of reports.

Warning

H317 (77.5%): May cause an allergic skin reaction [Warning Sensitization, Skin]

P203, P261, P271, P272, P280, P302+P352, P304+P340, P318, P319, P321, P333+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationStatus: Active Update: 09-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/25894
Other Safety InformationIMAP assessments - Acetamide, N-[(4-aminophenyl)sulfonyl]-: Environment tier I assessment
Fire HazardsFlash point data for this chemical are not available. It is probably combustible. (NTP, 1992)
Reactive GroupAmides and Imides
Reactivity Profile · 1건

SULFACETAMIDE is an amide. Organic amides/imides react with azo and diazo compounds to generate toxic gases. Flammable gases are formed by the reaction of organic amides/imides with strong reducing agents. Amides are very weak bases (weaker than water). Imides are less basic yet and in fact react with strong bases to form salts. That is, they can react as acids. Mixing amides with dehydrating agents such as P2O5 or SOCl2 generates the corresponding nitrile. The combustion of these compounds generate mixed oxides of nitrogen (NOx)

Air and Water ReactionsInsoluble in water.

안전 및 보호

Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid · 1건

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

Nonfire Spill Response · 1건

SMALL SPILLS AND LEAKAGE: Should a spill occur while you are handling this chemical, FIRST REMOVE ALL SOURCES OF IGNITION, then you should dampen the solid spill material with 60-70% ethanol and transfer the dampened material to a suitable container. Use absorbent paper dampened with 60-70% ethanol to pick up any remaining material. Seal the absorbent paper, and any of your clothes, which may be contaminated, in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with 60-70% ethanol followed by washing with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Personal Protective Equipment (PPE) · 1건

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

안전 데이터

wgk
2
tsca
TSCA listed
rtecs
AC8450000
독성
LD50 orally in dogs: 8000 mg/kg (Fisher)
HS 번호
29350090
risk_code
20/21/22-36/37/38

화학 및 산업

약리 정보

ATC Code · 5건

D - Dermatologicals

S - Sensory organs

QS - Sensory organs

QJ - Antiinfectives for systemic use

QD - Dermatologicals

Pharmacodynamics · 1건

Sulfacetamide is a sulfonamide antibiotic with bacteriostatic actions and broad-spectrum activity against most gram-positive and many gram-negative organisms. However, many strains of an individual species may be resistant. Sulfonamides inhibit multiplication of bacteria by acting as competitive inhibitors of <i>p</i>-aminobenzoic acid in the folic acid metabolism cycle. Bacterial sensitivity is the same for the various sulfonamides, and resistance to one sulfonamide indicates resistance to all. Most sulfonamides are readily absorbed orally. However, parenteral administration is difficult, since the soluble sulfonamide salts are highly alkaline and irritating to the tissues. The sulfonamides are widely distributed throughout all tissues. High levels are achieved in pleural, peritoneal, synovial, and ocular fluids. Although these drugs are no longer used to treat meningitis, CSF levels are high in meningeal infections. Their antibacterial action is inhibited by pus.

Mechanism of Action · 1건

Sulfacetamide is a competitive inhibitor of bacterial para-aminobenzoic acid (PABA), an essential component for bacterial growth (according to the Woods-Fildes theory). The inhibited reaction is necessary in these organisms for the synthesis of folic acid.

Biological Half-Life7-12.8 hours
FDA Pharmacological Classification · 5건

4965G3J0F5

SULFACETAMIDE

Established Pharmacologic Class [EPC] - Sulfonamide Antibacterial

Chemical Structure [CS] - Sulfonamides

Sulfacetamide is a Sulfonamide Antibacterial.

MeSH Pharmacological Classification · 3건

Substances used on humans and other animals that destroy harmful microorganisms or inhibit their activity. They are distinguished from DISINFECTANTS, which are used on inanimate objects.

Substances capable of killing agents causing urinary tract infections or of preventing them from spreading.

Substances that inhibit the growth or reproduction of BACTERIA.

용도 및 제조

Use ClassificationPharmaceuticals -> Animal Drugs -> Approved in Taiwan
General Manufacturing InformationAcetamide, N-[(4-aminophenyl)sulfonyl]-: ACTIVE

응용 분야

일반 설명Sulfacetamide’s plasmahalf-life is 7 hours. This compound is a white crystallinepowder, soluble in water (1:62.5 at 37°C) and in alcohol. It is very soluble in hot water, and its water solution is acidic.It has a pKa of 5.4.

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

추가 설명

정의ChEBI: A sulfonamide that is sulfanilamide acylated on the sulfonamide nitrogen.

관련 반응

13건

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